PUB - Publikationen an der Universität Bielefeld

Biradicaloid and Zwitterion Reactivity of Dicarbondiphosphide Stabilized with N-Heterocyclic Carbenes.
Li Z, Hou Y, Li Y, Hinz A, Chen X., Chemistry 24(19), 2018
PMID: 29247461

Trapping of transient, heavy pnictogen-centred biradicals.
Bresien J, Hinz A, Schulz A, Villinger A., Dalton Trans 47(13), 2018
PMID: 29492506

Extremely Long Lived Localized Singlet Diradicals in a Macrocyclic Structure: A Case Study on the Stretch Effect.
Harada Y, Wang Z, Kumashiro S, Hatano S, Abe M., Chemistry 24(55), 2018
PMID: 30019782

Theoretical Study on Open-Shell Singlet Character and Second Hyperpolarizabilities in Cofacial π-Stacked Dimers Composed of Weak Open-Shell Antiaromatic Porphyrins.
Fujiyoshi JY, Tonami T, Yamane M, Okada K, Kishi R, Muhammad S, Al-Sehemi AG, Nozawa R, Shinokubo H, Nakano M., Chemphyschem 19(21), 2018
PMID: 30080316

Recent developments in and perspectives on three-coordinate boron materials: a bright future.
Ji L, Griesbeck S, Marder TB., Chem Sci 8(2), 2017
PMID: 28572897

Direct Detection of a Chemical Equilibrium between a Localized Singlet Diradical and Its σ-Bonded Species by Time-Resolved UV/Vis and IR Spectroscopy.
Yoshidomi S, Mishima M, Seyama S, Abe M, Fujiwara Y, Ishibashi TA., Angew Chem Int Ed Engl 56(11), 2017
PMID: 28146310

An Isolable Diboron-Centered Diradical with a Triplet Ground State.
Wang L, Fang Y, Mao H, Qu Y, Zuo J, Zhang Z, Tan G, Wang X., Chemistry 23(28), 2017
PMID: 28342198

(L)2 C2 P2 : Dicarbondiphosphide Stabilized by N-Heterocyclic Carbenes or Cyclic Diamido Carbenes.
Li Z, Chen X, Andrada DM, Frenking G, Benkö Z, Li Y, Harmer JR, Su CY, Grützmacher H., Angew Chem Int Ed Engl 56(21), 2017
PMID: 28436079

N-Heterocyclic Vinylidene-Stabilized Phosphorus Biradicaloid.
Rottschäfer D, Neumann B, Stammler HG, Ghadwal RS., Chemistry 23(38), 2017
PMID: 28556982

Borylenes: An Emerging Class of Compounds.
Soleilhavoup M, Bertrand G., Angew Chem Int Ed Engl 56(35), 2017
PMID: 28577325

Triaminotriborane(3): A Homocatenated Boron Chain Connected by B-B Multiple Bonds.
Morisako S, Shang R, Yamamoto Y, Matsui H, Nakano M., Angew Chem Int Ed Engl 56(48), 2017
PMID: 28980375

Zwitterionic and biradicaloid heteroatomic cyclopentane derivatives containing different group 15 elements.
Hinz A, Schulz A, Villinger A., Chem Sci 7(1), 2016
PMID: 29896358

A Puckered Singlet Cyclopentane-1,3-diyl: Detection of the Third Isomer in Homolysis.
Ye J, Hatano S, Abe M, Kishi R, Murata Y, Nakano M, Adam W., Chemistry 22(7), 2016
PMID: 26751598

On the behaviour of biradicaloid [P(μ-NTer)]2 towards Lewis acids and bases.
Hinz A, Schulz A, Villinger A., Chem Commun (Camb) 52(37), 2016
PMID: 27086655

Computational insights into intriguing vibration-induced pulsing diradical character in perfluoropentacene and the perfluorination effect.
Zhang F, Feng Y, Song X, Bu Y., Phys Chem Chem Phys 18(24), 2016
PMID: 27250923

Thermally controlling the singlet-triplet energy gap of a diradical in the solid state.
Su Y, Wang X, Wang L, Zhang Z, Wang X, Song Y, Power PP., Chem Sci 7(10), 2016
PMID: 27928491

Hydroboration of Phosphaalkynes by HB(C6 F5 )2.
Longobardi LE, Johnstone TC, Falconer RL, Russell CA, Stephan DW., Chemistry 22(36), 2016
PMID: 27377569

Donor-Stabilized 1,3-Disila-2,4-diazacyclobutadiene with a Nonbonded Si⋅⋅⋅Si Distance Compressed to a Si=Si Double Bond Length.
Gau D, Nougué R, Saffon-Merceron N, Baceiredo A, De Cózar A, Cossío FP, Hashizume D, Kato T., Angew Chem Int Ed Engl 55(47), 2016
PMID: 27763730

A mixed arsenic-phosphorus centered biradicaloid.
Hinz A, Schulz A, Villinger A., Angew Chem Int Ed Engl 54(2), 2015
PMID: 25404061

Theoretical study on the relationship between diradical character and second hyperpolarizabilities of four-membered-ring diradicals involving heavy main-group elements.
Matsui H, Fukuda K, Takamuku S, Sekiguchi A, Nakano M., Chemistry 21(5), 2015
PMID: 25428227

Lowering the reduction potential of a boron compound by means of the substituent effect of the boryl group: one-electron reduction of an unsymmetrical diborane(4).
Asakawa H, Lee KH, Furukawa K, Lin Z, Yamashita M., Chemistry 21(11), 2015
PMID: 25639658

Structural fluctuation governed dynamic diradical character in pentacene.
Yang H, Chen M, Song X, Bu Y., Phys Chem Chem Phys 17(21), 2015
PMID: 25946577

A Phosphine-Coordinated Boron-Centered Gomberg-Type Radical.
Rosenthal AJ, Devillard M, Miqueu K, Bouhadir G, Bourissou D., Angew Chem Int Ed Engl 54(32), 2015
PMID: 26118986

Synthesis and structure of a 1-phospha-2-boraacenaphthene derivative and its chalcogenation reactions.
Tsurusaki A, Sasamori T, Tokitoh N., Chemistry 20(13), 2014
PMID: 24677485

Diradical character from the local spin analysis.
Ramos-Cordoba E, Salvador P., Phys Chem Chem Phys 16(20), 2014
PMID: 24728091

Activation of small molecules by phosphorus biradicaloids.
Hinz A, Kuzora R, Rosenthal U, Schulz A, Villinger A., Chemistry 20(45), 2014
PMID: 25266101

An arsenic-nitrogen biradicaloid: synthesis, properties, and reactivity.
Demeshko S, Godemann C, Kuzora R, Schulz A, Villinger A., Angew Chem Int Ed Engl 52(7), 2013
PMID: 23319315

Substituent effect on the energy barrier for σ-bond formation from π-single-bonded species, singlet 2,2-dialkoxycyclopentane-1,3-diyls.
Ye J, Fujiwara Y, Abe M., Beilstein J Org Chem 9(), 2013
PMID: 23766808

Silyl effects on 1,3-diphosphacyclobutane-2,4-diyl: ring-opening of tetrahydrofuran and promotion of reductive P-C cleavage.
Ito S, Ngo TT, Mikami K., Chem Asian J 8(9), 2013
PMID: 23749413

Kinetic stabilization and reactivity of π single-bonded species: effect of the alkoxy group on the lifetime of singlet 2,2-dialkoxy-1,3-diphenyloctahydropentalene-1,3-diyls.
Nakagaki T, Sakai T, Mizuta T, Fujiwara Y, Abe M., Chemistry 19(31), 2013
PMID: 23787808

Carbene-Stabilized Main Group Radicals and Radical Ions.
Martin CD, Soleilhavoup M, Bertrand G., Chem Sci 4(8), 2013
PMID: 23878717

A polycyclic borazine radical cation: [1,2-B2{1,2-(MeN)2C6H4}2]˙(+).
Xie X, Adams CJ, Al-Ibadi MA, McGrady JE, Norman NC, Russell CA., Chem Commun (Camb) 49(88), 2013
PMID: 24079005

Carbonylation of cyclotrisilenes.
Cowley MJ, Ohmori Y, Huch V, Ichinohe M, Sekiguchi A, Scheschkewitz D., Angew Chem Int Ed Engl 52(50), 2013
PMID: 24307015

Reactions of heavier main-group compounds with hydrogen, ammonia, ethylene and related small molecules.
Power PP., Chem Rec 12(2), 2012
PMID: 22180027

Theoretical design of the biradical character in 1,3-diphosphacyclobutanediyl and homologous structures.
Schoeller WW, Niecke E., Phys Chem Chem Phys 14(6), 2012
PMID: 22228139

Synthesis and characterization of a singlet delocalized 2,4-diimino-1,3-disilacyclobutanediyl and a silylenylsilaimine.
Zhang SH, Xi HW, Lim KH, Meng Q, Huang MB, So CW., Chemistry 18(14), 2012
PMID: 22378245

The chemistry of localized singlet 1,3-diradicals (biradicals): from putative intermediates to persistent species and unusual molecules with a π-single bonded character.
Abe M, Ye J, Mishima M., Chem Soc Rev 41(10), 2012
PMID: 22377794

The chemistry of four-membered aromatics.
Matsuo Y, Maruyama M., Chem Commun (Camb) 48(75), 2012
PMID: 22824955

Variational fractional-spin density-functional theory for diradicals.
Peng D, Hu X, Devarajan D, Ess DH, Johnson ER, Yang W., J Chem Phys 137(11), 2012
PMID: 22998254

Low band gap polycyclic hydrocarbons: from closed-shell near infrared dyes and semiconductors to open-shell radicals.
Sun Z, Ye Q, Chi C, Wu J., Chem Soc Rev 41(23), 2012
PMID: 22918297

Stable singlet carbenes as mimics for transition metal centers.
Martin D, Soleilhavoup M, Bertrand G., Chem Sci 2(3), 2011
PMID: 21743834

New perspectives for "non-classical" molecules: heavy [1.1.1]propellanes of group 14.
Nied D, Breher F., Chem Soc Rev 40(7), 2011
PMID: 21424005

[Sn4Si{Si(SiMe3)3}4{SiMe3}2]: a model compound for the unexpected first-order transition from a singlet biradicaloid to a classical bonded molecule.
Schrenk C, Kubas A, Fink K, Schnepf A., Angew Chem Int Ed Engl 50(32), 2011
PMID: 21698735

[P(μ-NTer)]2: a biradicaloid that is stable at high temperature.
Beweries T, Kuzora R, Rosenthal U, Schulz A, Villinger A., Angew Chem Int Ed Engl 50(38), 2011
PMID: 21858902

Synthesis of 1-phospha-2-boraacenaphthenes: reductive 1,2-aryl migration of 1-diarylboryl-8-dichlorophosphinonaphthalenes.
Tsurusaki A, Sasamori T, Wakamiya A, Yamaguchi S, Nagura K, Irle S, Tokitoh N., Angew Chem Int Ed Engl 50(46), 2011
PMID: 21948740

Substituents destabilize the molecule by increasing biradicaloid character and stabilize by intramolecular charge transfer in the derivatives of benzobis(thiadiazole) and thiadiazolothienopyrazine: a computational study.
Thomas A, Chaitanya GK, Bhanuprakash K, Prasad KM., Chemphyschem 12(17), 2011
PMID: 22076937

Main-group elements as transition metals.
Power PP., Nature 463(7278), 2010
PMID: 20075912

Synthesis and characterization of two of the three isomers of a germanium-substituted bicyclo[2.2.0]hexane diradicaloid: stretching the Ge-Ge bond.
Wang X, Peng Y, Zhu Z, Fettinger JC, Power PP, Guo J, Nagase S., Angew Chem Int Ed Engl 49(27), 2010
PMID: 20491109

Synthesis, structure, and theoretical investigation of amidinato supported 1,4-disilabenzene.
Sen SS, Roesky HW, Meindl K, Stern D, Henn J, Stückl AC, Stalke D., Chem Commun (Camb) 46(32), 2010
PMID: 20623067

Diverse reactions of sterically-protected 1,3-diphosphacyclobutane-2,4-diyls with hydride.
Ito S, Miura J, Morita N, Yoshifuji M, Arduengo AJ., Dalton Trans 39(35), 2010
PMID: 20686721

Boron atoms as spin carriers in two- and three-dimensional systems.
Kaim W, Hosmane NS, Zális S, Maguire JA, Lipscomb WN., Angew Chem Int Ed Engl 48(28), 2009
PMID: 19338002

Snapshots of the Al-Al sigma-bond formation starting from {AlR2} units: experimental and computational observations.
Henke P, Pankewitz T, Klöpper W, Breher F, Schnöckel H., Angew Chem Int Ed Engl 48(43), 2009
PMID: 19708044

Spirocyclic boronium ions: precursors to persistent neutral radicals.
Wood TK, Piers WE, Keay BA, Parvez M., Chem Commun (Camb) (34), 2009
PMID: 20448975

Butterfly and rhombus structures for binuclear cobalt carbonyl sulfur and phosphinidene complexes of the type Co2(CO)6E2 (E = S, PX).
Li G, Li QS, Silaghi-Dumitrescu I, King RB, Schaefer Iii HF., Dalton Trans (47), 2009
PMID: 20023869

The existence of two short-bond isomers for bicyclo[1.1.0]butane derivatives based on boron and phosphorus.
Gandon V, Bourg JB, Tham FS, Schoeller WW, Bertrand G., Angew Chem Int Ed Engl 47(1), 2008
PMID: 18022990

Poly(biradicals): oligomers of 1,3-diphosphacyclobutane-2,4-diyl units.
Ito S, Miura J, Morita N, Yoshifuji M, Arduengo AJ., Angew Chem Int Ed Engl 47(34), 2008
PMID: 18626880

1,3-Diborata-2,4-diphosphoniocyclobutane-1,3-diyls communicate through a para-phenylene linker.
Rodriguez A, Fuks G, Bourg JB, Bourissou D, Tham FS, Bertrand G., Dalton Trans (33), 2008
PMID: 18698452

Formation, structure and bonding of metalloid Al and Ga clusters. A challenge for chemical efforts in nanosciences.
Schnöckel H., Dalton Trans (33), 2008
PMID: 18698436

A 9-borylated acridinyl radical.
Chiu CW, Gabbaï FP., Angew Chem Int Ed Engl 46(10), 2007
PMID: 17397085

Thermal valence isomerization of 2,3-diborata-1,4-diphosphoniabuta-1,3-dienes to bicyclo[1.1.0]butanes and cyclobutane-1,3-diyls.
Bourg JB, Rodriguez A, Scheschkewitz D, Gornitzka H, Bourissou D, Bertrand G., Angew Chem Int Ed Engl 46(30), 2007
PMID: 17592605

Flexible coordination of the carboxylate ligand in tin(II) amides and a 1,3-diaza-2,4-distannacyclobutanediyl.
Dickie DA, Lee PT, Labeodan OA, Schatte G, Weinberg N, Lewis AR, Bernard GM, Wasylishen RE, Clyburne JA., Dalton Trans (27), 2007
PMID: 17607400

Advances in methods and algorithms in a modern quantum chemistry program package.
Shao Y, Molnar LF, Jung Y, Kussmann J, Ochsenfeld C, Brown ST, Gilbert AT, Slipchenko LV, Levchenko SV, O'Neill DP, DiStasio RA, Lochan RC, Wang T, Beran GJ, Besley NA, Herbert JM, Lin CY, Van Voorhis T, Chien SH, Sodt A, Steele RP, Rassolov VA, Maslen PE, Korambath PP, Adamson RD, Austin B, Baker J, Byrd EF, Dachsel H, Doerksen RJ, Dreuw A, Dunietz BD, Dutoi AD, Furlani TR, Gwaltney SR, Heyden A, Hirata S, Hsu CP, Kedziora G, Khalliulin RZ, Klunzinger P, Lee AM, Lee MS, Liang W, Lotan I, Nair N, Peters B, Proynov EI, Pieniazek PA, Rhee YM, Ritchie J, Rosta E, Sherrill CD, Simmonett AC, Subotnik JE, Woodcock HL, Zhang W, Bell AT, Chakraborty AK, Chipman DM, Keil FJ, Warshel A, Hehre WJ, Schaefer HF, Kong J, Krylov AI, Gill PM, Head-Gordon M., Phys Chem Chem Phys 8(27), 2006
PMID: 16902710

Origin of the enhancement of the second hyperpolarizability of singlet diradical systems with intermediate diradical character.
Nakano M, Kishi R, Ohta S, Takebe A, Takahashi H, Furukawa S, Kubo T, Morita Y, Nakasuji K, Yamaguchi K, Kamada K, Ohta K, Champagne B, Botek E., J Chem Phys 125(7), 2006
PMID: 16942328

Structure and reactivity of radical ions: new twists on old concepts.
Donoghue PJ, Wiest O., Chemistry 12(27), 2006
PMID: 16874832

An extremely long-lived singlet 4,4-dimethoxy-3,5-diphenylpyrazolidine-3,5-diyl derivative: a notable nitrogen-atom effect on intra- and intermolecular reactivity.
Abe M, Kubo E, Nozaki K, Matsuo T, Hayashi T., Angew Chem Int Ed Engl 45(46), 2006
PMID: 17061308

Synthesis, intermolecular interaction, and semiconductive behavior of a delocalized singlet biradical hydrocarbon.
Kubo T, Shimizu A, Sakamoto M, Uruichi M, Yakushi K, Nakano M, Shiomi D, Sato K, Takui T, Morita Y, Nakasuji K., Angew Chem Int Ed Engl 44(40), 2005
PMID: 16158453

Reactivity of the dimesityl-1,8-naphthalenediylborate anion: isolation of the borataalkene isomer and synthesis of 1,8-diborylnaphthalenes.
Hoefelmeyer JD, Solé S, Gabbaï FP., Dalton Trans (8), 2004
PMID: 15252669

How diradicaloid is a stable diradical?
Jung Y, Head-Gordon M., Chemphyschem 4(5), 2003
PMID: 12785272